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N-(3-chlorophenyl)-5-methyl-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-3-isoxazolecarboxamide
SpectraBase Compound ID 8OEWJ2fEwsI
InChI InChI=1S/C15H12ClN5O4/c1-9-13(8-20-7-12(6-17-20)21(23)24)14(19-25-9)15(22)18-11-4-2-3-10(16)5-11/h2-7H,8H2,1H3,(H,18,22)
InChIKey RRMGWKVFAGRQJC-UHFFFAOYSA-N
Mol Weight 361.75 g/mol
Molecular Formula C15H12ClN5O4
Exact Mass 361.057782 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KSOLgEQEMrC
Name N-(3-chlorophenyl)-5-methyl-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-3-isoxazolecarboxamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C15H12ClN5O4/c1-9-13(8-20-7-12(6-17-20)21(23)24)14(19-25-9)15(22)18-11-4-2-3-10(16)5-11/h2-7H,8H2,1H3,(H,18,22)
InChIKey RRMGWKVFAGRQJC-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31482
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 1842898; SBI_ID: SBI-031486
Temperature 308 °C